| 1 |
Interpretation of activation volumes for water exchange reactions revisited : Ab initio calculations for Al3+, Ga3+, and In3+, and new experimental data
Kowall T, Caravan P, Bourgeois H, Helm L, Rotzinger FP, Merbach AE
Journal of the American Chemical Society, 120(26), 6569, 1998 |
| 2 |
Molecular-Dynamics Simulation Study of 18-Crown-6 in Aqueous-Solution .2. Free-Energy Profile for the Association 18C6-Center-Dot-Center-Dot-Center-Dot-K+ in Water
Kowall T, Geiger A
Journal of Physical Chemistry, 99(15), 5240, 1995 |
| 3 |
Molecular-Dynamics Simulation Study of Lanthanide Ions Ln(3+) in Aqueous-Solution - Analysis of the Structure of the First Hydration Shell and of the Origin of Symmetry Fluctuations
Kowall T, Foglia F, Helm L, Merbach AE
Journal of Physical Chemistry, 99(35), 13078, 1995 |
| 4 |
Molecular-Dynamics Simulation Study of Lanthanide Ions Ln(3+) in Aqueous-Solution Including Water Polarization - Change in Coordination-Number from 9 to 8 Along the Series
Kowall T, Foglia F, Helm L, Merbach AE
Journal of the American Chemical Society, 117(13), 3790, 1995 |
| 5 |
Molecular-Dynamics Simulation Study of 18-Crown-6 in Aqueous-Solution .1. Structure and Dynamics of the Hydration Shell
Kowall T, Geiger A
Journal of Physical Chemistry, 98(24), 6216, 1994 |
